Thursday, July 28, 2011

All Chemical Compounds Information




Product OPENEYE NAME: 2,4-diaminophenol
CAS Name: 2,4-diaminophenol
IUPAC NAME: 2,4-diaminophenol
SYSTEMATIC NAME: 2,4-bis(azanyl)phenol
MOLECULAR FORMULA: C6H8N2O
MOLECULAR WEIGHT: 124.14052
SMILES: C1=CC(=C(C=C1N)N)O
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Product OPENEYE NAME: 2,5-dimethylphenol
CAS Name: 2,5-dimethylphenol
IUPAC NAME: 2,5-dimethylphenol
SYSTEMATIC NAME: 2,5-dimethylphenol
MOLECULAR FORMULA: C8H10O
MOLECULAR WEIGHT: 122.1644
SMILES: CC1=CC(=C(C=C1)C)O
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Product OPENEYE NAME: diethyl oxalate
CAS Name: oxalic acid diethyl ester
IUPAC NAME: diethyl oxalate
SYSTEMATIC NAME: diethyl ethanedioate
MOLECULAR FORMULA: C6H10O4
MOLECULAR WEIGHT: 146.1412
SMILES: CCOC(=O)C(=O)OCC
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Product OPENEYE NAME: 1,2,4,5-tetramethylbenzene
CAS Name: 1,2,4,5-tetramethylbenzene
IUPAC NAME: 1,2,4,5-tetramethylbenzene
SYSTEMATIC NAME: 1,2,4,5-tetramethylbenzene
MOLECULAR FORMULA: C10H14
MOLECULAR WEIGHT: 134.21816
SMILES: CC1=CC(=C(C=C1C)C)C
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Product OPENEYE NAME: 1,2,4,5-tetrachlorobenzene
CAS Name: 1,2,4,5-tetrachlorobenzene
IUPAC NAME: 1,2,4,5-tetrachlorobenzene
SYSTEMATIC NAME: 1,2,4,5-tetrakis(chloranyl)benzene
MOLECULAR FORMULA: C6H2Cl4
MOLECULAR WEIGHT: 215.89208
SMILES: C1=C(C(=CC(=C1Cl)Cl)Cl)Cl
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Product OPENEYE NAME: 2,4,5-trichlorophenol
CAS Name: 2,4,5-trichlorophenol
IUPAC NAME: 2,4,5-trichlorophenol
SYSTEMATIC NAME: 2,4,5-tris(chloranyl)phenol
MOLECULAR FORMULA: C6H3Cl3O
MOLECULAR WEIGHT: 197.44642
SMILES: C1=C(C(=CC(=C1Cl)Cl)Cl)O
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Product OPENEYE NAME: 3,6-dimethyl-1,4-dioxane-2,5-dione
CAS Name: 3,6-dimethyl-1,4-dioxane-2,5-dione
IUPAC NAME: 3,6-dimethyl-1,4-dioxane-2,5-dione
SYSTEMATIC NAME: 3,6-dimethyl-1,4-dioxane-2,5-dione
MOLECULAR FORMULA: C6H8O4
MOLECULAR WEIGHT: 144.12532
SMILES: CC1C(=O)OC(C(=O)O1)C
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Product OPENEYE NAME: allyl 2-methylprop-2-enoate
CAS Name: 2-methyl-2-propenoic acid prop-2-enyl ester
IUPAC NAME: prop-2-enyl 2-methylprop-2-enoate
SYSTEMATIC NAME: prop-2-enyl 2-methylprop-2-enoate
MOLECULAR FORMULA: C7H10O2
MOLECULAR WEIGHT: 126.1531
SMILES: CC(=C)C(=O)OCC=C
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Product OPENEYE NAME: 6-methyl-3-(3-methyloxiran-2-yl)-7-oxabicyclo[4.1.0]heptane
CAS Name: 6-methyl-3-(3-methyl-2-oxiranyl)-7-oxabicyclo[4.1.0]heptane
IUPAC NAME: 6-methyl-3-(3-methyloxiran-2-yl)-7-oxabicyclo[4.1.0]heptane
SYSTEMATIC NAME: 6-methyl-3-(3-methyloxiran-2-yl)-7-oxabicyclo[4.1.0]heptane
MOLECULAR FORMULA: C10H16O2
MOLECULAR WEIGHT: 168.23284
SMILES: CC1C(O1)C2CCC3(C(C2)O3)C
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Product OPENEYE NAME: 2-phenyloxirane
CAS Name: 2-phenyloxirane
IUPAC NAME: 2-phenyloxirane
SYSTEMATIC NAME: 2-phenyloxirane
MOLECULAR FORMULA: C8H8O
MOLECULAR WEIGHT: 120.14852
SMILES: C1C(O1)C2=CC=CC=C2
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Product OPENEYE NAME: chloro(diethyl)alumane
CAS Name: chloro(diethyl)alumane
IUPAC NAME: chloro(diethyl)alumane
SYSTEMATIC NAME: chloranyl(diethyl)alumane
MOLECULAR FORMULA: C4H10AlCl
MOLECULAR WEIGHT: 120.556738
SMILES: CC[Al](CC)Cl
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Product OPENEYE NAME: chloroalumane
CAS Name: chloroalumane
IUPAC NAME: chloroalumane
SYSTEMATIC NAME: chloranylalumane
MOLECULAR FORMULA: AlClH2
MOLECULAR WEIGHT: 64.450418
SMILES: [AlH2]Cl
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